SCHEMBL1471495

SCHEMBL1471495

O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCC(Oc2ccccc2C(F)(F)F)CC1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.62
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
HTT P42858 2/20 0.55
HSD11B1 P28845 1/20 0.53
CNR1 P21554 1/20 0.51
GAA P10253 2/20 0.50
HPGD P15428 1/20 0.50
PKM P14618 1/20 0.49
PKLR P30613 1/20 0.49
HTR2C P28335 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 4/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SCD O00767 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1471706 0.88 HSD11B1 (0.54) TP53KMT2AMEN1HSD11B1HTR2C
SCHEMBL12828374 0.86 TP53 (0.48) TP53KMT2AMEN1PKMHTR2C
SCHEMBL3222938 0.82 MEN1 (0.63) TP53KMT2AMEN1HTTHSD11B1
SCHEMBL1471602 0.81 KMT2A (0.65) KMT2AMEN1SMN1; SMN2LMNASCD
SCHEMBL1677064 0.81 TP53 (0.60) TP53KMT2AMEN1HTTHSD11B1
SCHEMBL7951897 0.81 KMT2A (0.61) TP53KMT2AMEN1HTTHSD11B1
SCHEMBL3210171 0.81 RBP4 (0.61) KMT2AHTTHSD11B1CNR1GAA
SCHEMBL1677163 0.78 KMT2A (0.58) TP53KMT2AMEN1HTTHSD11B1
SCHEMBL12727839 0.77 HTT (0.62) TP53KMT2AMEN1HTTHSD11B1
SCHEMBL18726870 0.77 ALDH1A1 (0.63) TP53KMT2AMEN1HTTCNR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651595-A2 UBIQUITIN LIGASE INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2006-05-03 EP claimed
WO-2005007621-A2 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2005-01-27 WO claimed
US-7915293-B2 Carbocyclic and heterocyclic sulfonamide derivatives, e.g., N-(2-bromo-5-(trifluoromethoxy)phenyl)-3,5-dichloro-4-(2-chloro-4-nitrophenoxy)benzenesulfonamide and 4-(2-(trifluoromethyl)phenoxy)-1-(3-trifluoromethyl)phenylsulfonyl)piperidine; treating proliferative diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-03-29 US disclosed
US-7915293-B2 Carbocyclic and heterocyclic sulfonamide derivatives, e.g., N-(2-bromo-5-(trifluoromethoxy)phenyl)-3,5-dichloro-4-(2-chloro-4-nitrophenoxy)benzenesulfonamide and 4-(2-(trifluoromethyl)phenoxy)-1-(3-trifluoromethyl)phenylsulfonyl)piperidine; treating proliferative diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-03-29 US disclosed
WO-2005007621-A2 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2005-01-27 WO disclosed
US-20050009871-A1 Ubiquitin ligase inhibitors RIGEL PHARMACEUTICALS, INC. 2005-01-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050009871-A1 Ubiquitin ligase inhibitors NEDD4, STUB1, UBE3A TP53 278/4885KMT2A 1014/4885MEN1 3441/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.